Chem
J-GLOBAL ID:200907089132571369
Nikkaji number:J1.486.442C
N-(Benzyloxycarbonyl)-O-[2-azido-3-O-(2-O,3-O,4-O,6-O-tetraacetyl-β-D-galactopyranosyl)-4-O,6-O-(di-tert-butylsilanediyl)-2-deoxy-α-D-galactopyranosyl]-L-serine benzyl ester
N-(ベンジルオキシカルボニル)-O-[2-アジド-3-O-(2-O,3-O,4-O,6-O-テトラアセチル-β-D-ガラクトピラノシル)-4-O,6-O-(ジ-tert-ブチルシランジイル)-2-デオキシ-α-D-ガラクトピラノシル]-L-セリンベンジル
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Substance type:
Substance type
Substance type classified into 3 categories. Decided structure: Substances with a clear structure Undicided Structure: Substances with unknown or undetermined structure Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula:
C46 H62 N2 [N-][N+]O18 Si
Molecular formula furigana:
C46-H62-N4-O18-SI
Molecular weight:
987.097
InChI:
InChI=1S/C46H62N4O18Si/c1-26(51)57-24-33-36(62-27(2)52)39(63-28(3)53)40(64-29(4)54)43(66-33)67-38-35(49-50-47)42(65-34-25-61-69(45(5,6)7,46(8,9)10)68-37(34)38)59-23-32(41(55)58-21-30-17-13-11-14-18-30)48-44(56)60-22-31-19-15-12-16-20-31/h11-20,32-40,42-43H,21-25H2,1-10H3,(H,48,56)/t32-,33+,34+,35+,36-,37-,38+,39-,40+,42-,43-/m0/s1
InChI key:
SXNYIKITJLWDPS-CYAMVCNPSA-N
SMILES:
CC(=O)OC[C@H]1O[C@@H](O[C@H]2[C@H]3O[Si](OC[C@H]3O[C@H](OC[C@H](NC(=O)OCc3ccccc3)C(=O)OCc3ccccc3)[C@@H]2N=[N+]=[N-])(C(C)(C)C)C(C)(C)C)[C@H](OC(=O)C)[C@@H](OC(=O)C)[C@H]1OC(=O)C
Systematic name (3):
N-(ベンジルオキシカルボニル)-O-[2-アジド-3-O-(2-O,3-O,4-O,6-O-テトラアセチル-β-D-ガラクトピラノシル)-4-O,6-O-(ジ-tert-ブチルシランジイル)-2-デオキシ-α-D-ガラクトピラノシル]-L-セリンベンジル
ベンジル (2S)-3-{[(4aR,6S,7R,8R,8aR)-7-アジド-2,2-ジ-tert-ブチル-8-{[(2R,3R,4S,5S,6R)-3,4,5-トリス(アセチルオキシ)-6-[(アセチルオキシ)メチル]オキサン-2-イル]オキシ}-ヘキサヒドロ-2H-ピラノ[3,2-d][1,3,2]ジオキサシリン-6-イル]オキシ}-2-{[(ベンジルオキシ)カルボニル]アミノ}プロパノアート
benzyl (2S)-3-{[(4aR,6S,7R,8R,8aR)-7-azido-2,2-di-tert-butyl-8-{[(2R,3R,4S,5S,6R)-3,4,5-tris(acetyloxy)-6-[(acetyloxy)methyl]oxan-2-yl]oxy}-hexahydro-2H-pyrano[3,2-d][1,3,2]dioxasilin-6-yl]oxy}-2-{[(benzyloxy)carbonyl]amino}propanoate
Other name (1):
N-(Benzyloxycarbonyl)-O-[2-azido-3-O-(2-O,3-O,4-O,6-O-tetraacetyl-β-D-galactopyranosyl)-4-O,6-O-(di-tert-butylsilanediyl)-2-deoxy-α-D-galactopyranosyl]-L-serine benzyl ester
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